Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2157008 | 0.87 | RYR2 (0.35) | — | |
| SCHEMBL2156569 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL2155601 | 0.79 | — | — | |
| SCHEMBL2155555 | 0.79 | MEN1 (0.31) | — | |
| SCHEMBL2157076 | 0.75 | HSD11B1 (0.33) | — | |
| SCHEMBL2748203 | 0.62 | ALDH1A1 (0.41) | ACHE | |
| SCHEMBL14991466 | 0.61 | PSEN1 (0.39) | — | |
| SCHEMBL21300911 | 0.61 | ALDH1A1 (0.50) | — | |
| SCHEMBL14991258 | 0.61 | PSEN1 (0.39) | — | |
| SCHEMBL10382676 | 0.60 | SMN1; SMN2 (0.44) | NOTUMACHE |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7973072-B2 | Pain, eating disorders, neurodegenerative disorders, memory impairment; attention deficit syndrome, opioid tolerance, drug addiction; (4-oxothiochroman-3,3-diyl)bis(methylene)bis(3-(trifluoromethyl)benzoate for example | GRUENENTHAL GMBH (DE) | 2011-07-05 | — | — | US | claimed |
| US-7973072-B2 | Pain, eating disorders, neurodegenerative disorders, memory impairment; attention deficit syndrome, opioid tolerance, drug addiction; (4-oxothiochroman-3,3-diyl)bis(methylene)bis(3-(trifluoromethyl)benzoate for example | GRUENENTHAL GMBH (DE) | 2011-07-05 | — | — | US | disclosed |